Compound Identification
SMILES
CCCOC(=O)CCCCC1SCC2NC(=O)NC12
InChIKey
InChIKey=JCWKQGVHQJEXGR-UHFFFAOYSA-N
Formula
C13H22N2O3S
Mass
286.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Biotin and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Biotin and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Biotin and derivatives
Alternative Parents
Thienoimidazolidines Fatty acid esters Imidazolidinones Thiophenes Thiolanes Ureas Carboxylic acid esters Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Biotin_derivative - Biotin - Thienoimidazolidine - Fatty acid ester - Fatty acyl - Imidazolidinone - Imidazolidine - Thiolane - Thiophene - Carboxylic acid ester - Urea - Monocarboxylic acid or derivatives - Dialkylthioether - Azacycle - Carboxylic acid derivative - Thioether - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as biotin and derivatives. These are organic compounds containing a ureido (tetrahydroimidizalone) ring fused with a tetrahydrothiophene ring.
External Descriptors
Not available